1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide

C13H14N4O2 — CID 168697119

IUPAC1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCn1cc2cc(N3CC(C(N)=O)CC3=O)ccc2n1
InChIInChI=1S/C13H14N4O2/c1-16-6-8-4-10(2-3-11(8)15-16)17-7-9(13(14)19)5-12(17)18/h2-4,6,9H,5,7H2,1H3,(H2,14,19)
InChIKeyCJGDGFYDQKNOMN-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.41
Rot. Bonds2

About 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide

1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168697119) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168697119
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCn1cc2cc(N3CC(C(N)=O)CC3=O)ccc2n1
InChIInChI=1S/C13H14N4O2/c1-16-6-8-4-10(2-3-11(8)15-16)17-7-9(13(14)19)5-12(17)18/h2-4,6,9H,5,7H2,1H3,(H2,14,19)
InChIKeyCJGDGFYDQKNOMN-UHFFFAOYSA-N
XLogP0.41
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(aminomethyl)-1-(2-methylindazol-5-yl)pyrrolidin-2-one
CID 168660099
S-[1-(2-methylindazol-5-yl)-5-oxopyrrolidin-3-yl] ethanethioate
CID 168705873
1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711992
1-(2-methylindazol-5-yl)-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168670795
S-[[1-(2-methylindazol-5-yl)-5-oxopyrrolidin-3-yl]methyl] ethanethioate
CID 168667466
6-(4-carbamoyl-2-oxopyrrolidin-1-yl)naphthalene-2-carboxylic acid
CID 168698344
(3S)-1-[3-[(4R)-4-carbamoyl-2-oxopyrrolidin-1-yl]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 94076238
1-(4-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697847
(3R)-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 704642
1-(3-amino-4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 50874085
1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17120547
(3R)-1-(3-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 94076150

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide (CID 168697119) is 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide is Cn1cc2cc(N3CC(C(N)=O)CC3=O)ccc2n1.
What is the InChIKey of 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is CJGDGFYDQKNOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-16-6-8-4-10(2-3-11(8)15-16)17-7-9(13(14)19)5-12(17)18/h2-4,6,9H,5,7H2,1H3,(H2,14,19).
What are the key properties of 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide?
1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylindazol-5-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168697119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).